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19-O-DECANOYL-14,15,16-TRIACETYL-14,15,16,19-TETRAHYDROXY-ENT-MANOYLOXIDE;MIXTURE_OF_ACYL
SpectraBase Compound ID H16QSxMTMnF
InChI InChI=1S/C36H60O9/c1-8-9-10-11-12-13-14-16-32(40)43-24-33(5)19-15-20-34(6)29(33)17-21-35(7)30(34)18-22-36(45-35,25-42-27(3)38)31(44-28(4)39)23-41-26(2)37/h29-31H,8-25H2,1-7H3/t29-,30+,31+,33+,34-,35+,36+/m1/s1
InChIKey KBDMFWDICZEXJT-GHOFNDHLSA-N
Mol Weight 636.9 g/mol
Molecular Formula C36H60O9
Exact Mass 636.423734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KO2dYC3ipz5
Name 19-O-DECANOYL-14,15,16-TRIACETYL-14,15,16,19-TETRAHYDROXY-ENT-MANOYLOXIDE;MIXTURE_OF_ACYL
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H60O9
InChI InChI=1S/C36H60O9/c1-8-9-10-11-12-13-14-16-32(40)43-24-33(5)19-15-20-34(6)29(33)17-21-35(7)30(34)18-22-36(45-35,25-42-27(3)38)31(44-28(4)39)23-41-26(2)37/h29-31H,8-25H2,1-7H3/t29-,30+,31+,33+,34-,35+,36+/m1/s1
InChIKey KBDMFWDICZEXJT-GHOFNDHLSA-N
Literature Reference Author A.L.PEREZ-CASTORENA,M.MARTINEZ-VAZQUEZ,A.R.D.VIVAR
Literature Reference Citation PHYTOCHEM.,46,729(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00235-5
Molecular Weight 636.867 g/mol
Sample ID 44934
Solvent CDCl3